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Thiazol-4(5H)-one, 5-fluoro-5-trifluoromethyl-2-[3-(3-trifluoromethylphenyl)ureido]-
SpectraBase Compound ID 8djm0jl8TVe
InChI InChI=1S/C12H6F7N3O2S/c13-10(12(17,18)19)7(23)21-9(25-10)22-8(24)20-6-3-1-2-5(4-6)11(14,15)16/h1-4H,(H2,20,21,22,23,24)
InChIKey ZJEUMCUVWHWNLF-UHFFFAOYSA-N
Mol Weight 389.25 g/mol
Molecular Formula C12H6F7N3O2S
Exact Mass 389.006895 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID O1WmMKic31
Name urea, N-[5-fluoro-4,5-dihydro-4-oxo-5-(trifluoromethyl)-2-thiazolyl]-N'-[3-(trifluoromethyl)phenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 389.006894758 u
Formula C12H6F7N3O2S
InChI InChI=1S/C12H6F7N3O2S/c13-10(12(17,18)19)7(23)21-9(25-10)22-8(24)20-6-3-1-2-5(4-6)11(14,15)16/h1-4H,(H2,20,21,22,23,24)
InChIKey ZJEUMCUVWHWNLF-UHFFFAOYSA-N
Molecular Weight 389.248 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5384
Solvent DMSO-d6
Source Vendor ID: NMR/9233274; Lab Info: AU; Lab Number: AU-TG00705